%chk=000065871.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065871

0 1
 O    2.722500     -0.2876000      -1.190500    
 O   -1.752600       2.116400      0.7581000    
 O   -1.765000      -1.884200      0.2223000    
 N   0.5020000       2.300200      0.1636000    
 N   -3.075000      4.1099999E-02 -0.1350000    
 N   -5.463600      0.2884000     -0.2535000    
 N   -4.604900      -1.774500      0.1134000    
 N   -6.388500     -0.6731000     -0.1243000    
 N   -5.925100      -1.911600      9.3999997E-02
 C    1.663800       1.684600     -0.3398000    
 C    1.625700      0.3842000     -0.6906000    
 C  -0.7111000      0.1781000     -8.0200002E-02
 C  -0.7146000       1.618100      0.3219000    
 C   0.4088000     -0.3805000     -0.5557000    
 C    2.887600       2.473000     -0.4703000    
 C   0.5996000       3.646100      0.5105000    
 C    2.915500       3.764300     -0.1184000    
 C    1.719500       4.372800      0.3932000    
 C   -1.897600     -0.6776000      2.0900000E-02
 C    3.159900      -1.368800     -0.4804000    
 C    3.276700      -1.286800      0.9049000    
 C    3.487800      -2.547500      -1.145200    
 C    3.724200      -2.391200       1.630000    
 C    3.935100      -3.651900     -0.4201000    
 C   -4.383800     -0.4581000     -9.6299998E-02
 C    4.053200      -3.573800      0.9675000    
 H   0.4288000      -1.417300     -0.8789000    
 H    3.788000       2.007000     -0.8577000    
 H  -0.3008000       4.112200      0.8976000    
 H    3.815000       4.361000     -0.2093000    
 H    1.746000       5.418300      0.6769000    
 H   -3.035500       1.040300     -0.3168000    
 H    3.046800     -0.3739000       1.446800    
 H    3.397100      -2.613500      -2.225900    
 H    3.820600      -2.329200       2.710100    
 H    4.191500      -4.572600     -0.9359000    
 H    4.402600      -4.433300       1.532000    
 H   -7.381400     -0.4753000     -0.1885000    


%chk=000065871-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065871

0 1
O 2.936352 -0.242149 -0.756218
O -1.871156 2.436357 0.130319
O -1.889421 -1.841188 -0.267521
N 0.467839 2.420383 -0.124442
N -3.173440 0.117264 0.043524
N -5.525608 0.432405 0.302003
N -4.817363 -1.765375 0.090535
N -6.551498 -0.473464 0.351375
N -6.168545 -1.799624 0.227468
C 1.702543 1.754740 -0.308426
C 1.687963 0.341546 -0.453047
C -0.750503 0.290554 -0.197021
C -0.815760 1.719943 -0.050736
C 0.481019 -0.366398 -0.406946
C 2.898180 2.540124 -0.354376
C 0.427334 3.812833 0.002044
C 2.851081 3.923832 -0.223318
C 1.581876 4.570533 -0.044452
C -1.976818 -0.586133 -0.146162
C 3.308889 -1.501748 -0.199460
C 2.847775 -1.959993 1.054859
C 4.243667 -2.240021 -0.955620
C 3.333188 -3.192591 1.547125
C 4.722885 -3.466076 -0.446049
C -4.449105 -0.411715 0.137595
C 4.268149 -3.949015 0.803894
H 0.444918 -1.454169 -0.533151
H 3.835605 1.999798 -0.499962
H -0.580773 4.210318 0.137235
H 3.770396 4.515446 -0.257200
H 1.508866 5.655844 0.057266
H -3.071081 1.155776 0.123655
H 2.130439 -1.375885 1.639388
H 4.575117 -1.850026 -1.922510
H 2.976986 -3.557895 2.516306
H 5.445974 -4.046013 -1.029493
H 4.636046 -4.904003 1.192772
H -7.523215 -0.190416 0.469145


